# generated using pymatgen
data_Tm3Sn3Ir2Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.56574122
_cell_length_b   7.56574065
_cell_length_c   3.68926911
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000686
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm3Sn3Ir2Ru
_chemical_formula_sum   'Tm3 Sn3 Ir2 Ru1'
_cell_volume   182.88322391
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Tm  Tm0  1  0.00000000  0.40381944  0.50000000  1.0
  Tm  Tm1  1  0.59618056  0.59618056  0.50000000  1.0
  Tm  Tm2  1  0.40381944  0.00000000  0.50000000  1.0
  Sn  Sn3  1  1.00000000  0.73477318  0.00000000  1.0
  Sn  Sn4  1  0.26522682  0.26522682  0.00000000  1.0
  Sn  Sn5  1  0.73477318  1.00000000  0.00000000  1.0
  Ir  Ir6  1  0.33333300  0.66666700  0.00000000  1.0
  Ir  Ir7  1  0.66666700  0.33333300  0.00000000  1.0
  Ru  Ru8  1  0.00000000  0.00000000  0.50000000  1.0